3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one

C15H31N3O — CID 83238825

IUPAC3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one
SMILESCCN(CC)CCCC(C)N1C(=O)CNC1C(C)C
InChIInChI=1S/C15H31N3O/c1-6-17(7-2)10-8-9-13(5)18-14(19)11-16-15(18)12(3)4/h12-13,15-16H,6-11H2,1-5H3
InChIKeyWAKSLVCVWFIROE-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.91
Rot. Bonds8

About 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one

3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one (PubChem CID 83238825) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one
PubChem CID83238825
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one
SMILESCCN(CC)CCCC(C)N1C(=O)CNC1C(C)C
InChIInChI=1S/C15H31N3O/c1-6-17(7-2)10-8-9-13(5)18-14(19)11-16-15(18)12(3)4/h12-13,15-16H,6-11H2,1-5H3
InChIKeyWAKSLVCVWFIROE-UHFFFAOYSA-N
XLogP1.91
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one (CID 83238825) is 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one is CCN(CC)CCCC(C)N1C(=O)CNC1C(C)C.
What is the InChIKey of 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one?
The InChIKey is WAKSLVCVWFIROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-6-17(7-2)10-8-9-13(5)18-14(19)11-16-15(18)12(3)4/h12-13,15-16H,6-11H2,1-5H3.
What are the key properties of 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one?
3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one has a molecular weight of 269.43 g/mol, XLogP of 1.91, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(diethylamino)pentan-2-yl]-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83238825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).